In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 15 | Yes |
Popular Name: (2R)-2-(3-methyl-2-thienyl)-2-(1-piperidyl)ethanamine (2R)-2-(3-methyl-2-thienyl)-2-(1…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.91 | 4 | -45.38 | 3 | 2 | 1 | 31 | 225.381 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 5.2 | -26.99 | 3 | 2 | 1 | 30 | 225.381 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.91 | 5.89 | -127.06 | 4 | 2 | 2 | 32 | 226.389 | 3 | ↓ |